 Home > Encyclopedia > 5-amino-7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid,hydrochloride

5-amino-7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid,hydrochloride

5-amino-7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid,hydrochloride structure

CAS No:
178173-92-7
Formula:
C18H22ClFN4O4
Chemical Name:
5-amino-7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid,hydrochloride

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5-amino-7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid,hydrochloride Basic Attributes

Molecular Weight：

412.84300

Exact Mass：

412.1313611

DSSTox ID：

DTXSID60170435

Characteristics

PSA：

123.81000

XLogP3：

3.45040

Boiling Point：

677.1ºC at 760 mmHg

Flash Point：

363.3ºC

Vapor Pressure：

2.93E-19mmHg at 25°C

Computed Properties

Molecular Weight:412.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:412.1313611
Monoisotopic Mass:412.1313611
Topological Polar Surface Area:122
Heavy Atom Count:28
Complexity:670
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 5-amino-7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid,hydrochloride

Basic Attributes
Characteristics
Computed Properties
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